4-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-chloranyl-1-hexyl-benzene

Systemtic Name: 4-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-chloranyl-1-hexyl-benzene Openeye Name: 4-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-chloro-1-hexyl-benzene CAS Name: 4-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-chloro-1-hexylbenzene IUPAC Name: 4-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-chloro-1-hexylbenzene Traditional Name: 4-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-chloro-1-hexyl-benzene Formula: C30H39Cl MolecularWeight: 435.08366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CCCC)Cl

Isomeric SMILES

CCCCCCC1=C(C=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CCCC)Cl

InChI

InChI=1S/C30H39Cl/c1-3-5-7-8-10-29-22-17-26(23-30(29)31)12-11-25-15-20-28(21-16-25)27-18-13-24(14-19-27)9-6-4-2/h13-14,17-19,22-23,25,28H,3-10,15-16,20-21H2,1-2H3